Found 14 hits of Enzyme Inhibition Constant Data Target/Host
(Institution) | Ligand | Target/Host
Links | Ligand
Links | Trg + Lig
Links | Ki
nM | ΔG°
kJ/mole | IC50
nM | Kd
nM | EC50/IC50
nM | koff
s-1 | kon
M-1s-1 | pH | Temp
°C |
|---|
Histone deacetylase
(Homo sapiens (Human)) | BDBM50475498
(CHEMBL558588)Show SMILES Br.CC(C)(C)c1ccc(CNCCCCNCCCNC(=O)CCCCC(=O)NO)cc1 Show InChI InChI=1S/C24H42N4O3/c1-24(2,3)21-13-11-20(12-14-21)19-26-16-7-6-15-25-17-8-18-27-22(29)9-4-5-10-23(30)28-31/h11-14,25-26,31H,4-10,15-19H2,1-3H3,(H,27,29)(H,28,30) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 2.51E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Wayne State University
Curated by ChEMBL
| Assay Description
In vitro inhibitory concentration against Histone deacetylase (HDAC) at 1 uM concentration |
J Med Chem 48: 6350-65 (2005)
Article DOI: 10.1021/jm0505009
BindingDB Entry DOI: 10.7270/Q2KW5JSP |
More data for this
Ligand-Target Pair | |
Histone deacetylase
(Homo sapiens (Human)) | BDBM50475496
(CHEMBL537415)Show SMILES Br.ONC(=O)CCCCCCC(=O)NCCCNCCCCNCCC(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C30H46N4O3/c35-29(18-9-1-2-10-19-30(36)34-37)33-24-13-23-31-21-11-12-22-32-25-20-28(26-14-5-3-6-15-26)27-16-7-4-8-17-27/h3-8,14-17,28,31-32,37H,1-2,9-13,18-25H2,(H,33,35)(H,34,36) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 2.62E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Wayne State University
Curated by ChEMBL
| Assay Description
In vitro inhibitory concentration against Histone deacetylase (HDAC) at 1 uM concentration |
J Med Chem 48: 6350-65 (2005)
Article DOI: 10.1021/jm0505009
BindingDB Entry DOI: 10.7270/Q2KW5JSP |
More data for this
Ligand-Target Pair | |
Histone deacetylase
(Homo sapiens (Human)) | BDBM50475493
(CHEMBL540877)Show SMILES Br.CN(C)c1ccc(CN(CCCNCCCCN)C(=O)CCCCC(=O)NO)cc1 Show InChI InChI=1S/C22H39N5O3/c1-26(2)20-12-10-19(11-13-20)18-27(17-7-16-24-15-6-5-14-23)22(29)9-4-3-8-21(28)25-30/h10-13,24,30H,3-9,14-18,23H2,1-2H3,(H,25,28) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 4.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Wayne State University
Curated by ChEMBL
| Assay Description
In vitro inhibitory concentration against Histone deacetylase (HDAC) at 1 uM concentration |
J Med Chem 48: 6350-65 (2005)
Article DOI: 10.1021/jm0505009
BindingDB Entry DOI: 10.7270/Q2KW5JSP |
More data for this
Ligand-Target Pair | |
Histone deacetylase
(Homo sapiens (Human)) | BDBM50475491
(CHEMBL372863)Show SMILES OC(=O)C(F)(F)F.Cc1ccc(CNCCCCNC(=O)CCCCCCC(=O)NO)cc1 Show InChI InChI=1S/C20H33N3O3/c1-17-10-12-18(13-11-17)16-21-14-6-7-15-22-19(24)8-4-2-3-5-9-20(25)23-26/h10-13,21,26H,2-9,14-16H2,1H3,(H,22,24)(H,23,25) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 4.68E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Wayne State University
Curated by ChEMBL
| Assay Description
In vitro inhibitory concentration against Histone deacetylase (HDAC) at 1 uM concentration |
J Med Chem 48: 6350-65 (2005)
Article DOI: 10.1021/jm0505009
BindingDB Entry DOI: 10.7270/Q2KW5JSP |
More data for this
Ligand-Target Pair | |
Histone deacetylase
(Homo sapiens (Human)) | BDBM50475504
(CHEMBL1162919)Show SMILES Br.CC(C)(C)c1ccc(CNCCCCNCCCNC(=O)CCCCCCC(=O)NO)cc1 Show InChI InChI=1S/C26H46N4O3/c1-26(2,3)23-15-13-22(14-16-23)21-28-18-9-8-17-27-19-10-20-29-24(31)11-6-4-5-7-12-25(32)30-33/h13-16,27-28,33H,4-12,17-21H2,1-3H3,(H,29,31)(H,30,32) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 5.06E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Wayne State University
Curated by ChEMBL
| Assay Description
In vitro inhibitory concentration against Histone deacetylase (HDAC) at 1 uM concentration |
J Med Chem 48: 6350-65 (2005)
Article DOI: 10.1021/jm0505009
BindingDB Entry DOI: 10.7270/Q2KW5JSP |
More data for this
Ligand-Target Pair | |
Histone deacetylase
(Homo sapiens (Human)) | BDBM50475494
(CHEMBL195940)Show InChI InChI=1S/C18H29N3O3/c1-15-8-10-16(11-9-15)14-19-12-4-5-13-20-17(22)6-2-3-7-18(23)21-24/h8-11,19,24H,2-7,12-14H2,1H3,(H,20,22)(H,21,23) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 5.58E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Wayne State University
Curated by ChEMBL
| Assay Description
In vitro inhibitory concentration against Histone deacetylase (HDAC) at 1 uM concentration |
J Med Chem 48: 6350-65 (2005)
Article DOI: 10.1021/jm0505009
BindingDB Entry DOI: 10.7270/Q2KW5JSP |
More data for this
Ligand-Target Pair | |
Histone deacetylase
(Homo sapiens (Human)) | BDBM50475502
(CHEMBL536500)Show SMILES Br.ONC(=O)CCCCC(=O)NCCCNCCCNCCCNCCCNCC1CCCCCC1 Show InChI InChI=1S/C26H54N6O3/c33-25(13-5-6-14-26(34)32-35)31-22-10-20-29-18-8-16-27-15-7-17-28-19-9-21-30-23-24-11-3-1-2-4-12-24/h24,27-30,35H,1-23H2,(H,31,33)(H,32,34) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 5.90E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Wayne State University
Curated by ChEMBL
| Assay Description
In vitro inhibitory concentration against Histone deacetylase (HDAC) at 1 uM concentration |
J Med Chem 48: 6350-65 (2005)
Article DOI: 10.1021/jm0505009
BindingDB Entry DOI: 10.7270/Q2KW5JSP |
More data for this
Ligand-Target Pair | |
Histone deacetylase
(Homo sapiens (Human)) | BDBM50475495
(CHEMBL197431)Show SMILES OC(=O)C(F)(F)F.CN(C)c1ccc(CNCCCCNC(=O)CCCCCCC(=O)NO)cc1 Show InChI InChI=1S/C21H36N4O3/c1-25(2)19-13-11-18(12-14-19)17-22-15-7-8-16-23-20(26)9-5-3-4-6-10-21(27)24-28/h11-14,22,28H,3-10,15-17H2,1-2H3,(H,23,26)(H,24,27) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 6.61E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Wayne State University
Curated by ChEMBL
| Assay Description
In vitro inhibitory concentration against Histone deacetylase (HDAC) at 1 uM concentration |
J Med Chem 48: 6350-65 (2005)
Article DOI: 10.1021/jm0505009
BindingDB Entry DOI: 10.7270/Q2KW5JSP |
More data for this
Ligand-Target Pair | |
Histone deacetylase
(Homo sapiens (Human)) | BDBM50475497
(CHEMBL537640)Show SMILES Br.ONC(=O)CCCCC(=O)NCCCNCCCCNCCC(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C28H42N4O3/c33-27(16-7-8-17-28(34)32-35)31-22-11-21-29-19-9-10-20-30-23-18-26(24-12-3-1-4-13-24)25-14-5-2-6-15-25/h1-6,12-15,26,29-30,35H,7-11,16-23H2,(H,31,33)(H,32,34) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 8.03E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Wayne State University
Curated by ChEMBL
| Assay Description
In vitro inhibitory concentration against Histone deacetylase (HDAC) at 1 uM concentration |
J Med Chem 48: 6350-65 (2005)
Article DOI: 10.1021/jm0505009
BindingDB Entry DOI: 10.7270/Q2KW5JSP |
More data for this
Ligand-Target Pair | |
Histone deacetylase
(Homo sapiens (Human)) | BDBM50475503
(CHEMBL194361)Show InChI InChI=1S/C23H31N3O3/c27-22(14-6-7-15-23(28)26-29)25-17-9-8-16-24-18-20-12-4-5-13-21(20)19-10-2-1-3-11-19/h1-5,10-13,24,29H,6-9,14-18H2,(H,25,27)(H,26,28) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 8.37E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Wayne State University
Curated by ChEMBL
| Assay Description
In vitro inhibitory concentration against Histone deacetylase (HDAC) at 1 uM concentration |
J Med Chem 48: 6350-65 (2005)
Article DOI: 10.1021/jm0505009
BindingDB Entry DOI: 10.7270/Q2KW5JSP |
More data for this
Ligand-Target Pair | |
Histone deacetylase
(Homo sapiens (Human)) | BDBM50475500
(CHEMBL199188)Show SMILES OC(=O)C(F)(F)F.CN(C)c1ccc(CN(CCCCN)C(=O)CCCCCCC(=O)NO)cc1 Show InChI InChI=1S/C21H36N4O3/c1-24(2)19-13-11-18(12-14-19)17-25(16-8-7-15-22)21(27)10-6-4-3-5-9-20(26)23-28/h11-14,28H,3-10,15-17,22H2,1-2H3,(H,23,26) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 8.44E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Wayne State University
Curated by ChEMBL
| Assay Description
In vitro inhibitory concentration against Histone deacetylase (HDAC) at 1 uM concentration |
J Med Chem 48: 6350-65 (2005)
Article DOI: 10.1021/jm0505009
BindingDB Entry DOI: 10.7270/Q2KW5JSP |
More data for this
Ligand-Target Pair | |
Histone deacetylase
(Homo sapiens (Human)) | BDBM50475492
(CHEMBL199276)Show SMILES OC(=O)C(F)(F)F.CN(C)c1ccc(CNCCCCNC(=O)CCCCC(=O)NO)cc1 Show InChI InChI=1S/C19H32N4O3/c1-23(2)17-11-9-16(10-12-17)15-20-13-5-6-14-21-18(24)7-3-4-8-19(25)22-26/h9-12,20,26H,3-8,13-15H2,1-2H3,(H,21,24)(H,22,25) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 8.97E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Wayne State University
Curated by ChEMBL
| Assay Description
In vitro inhibitory concentration against Histone deacetylase (HDAC) at 1 uM concentration |
J Med Chem 48: 6350-65 (2005)
Article DOI: 10.1021/jm0505009
BindingDB Entry DOI: 10.7270/Q2KW5JSP |
More data for this
Ligand-Target Pair | |
Histone deacetylase
(Homo sapiens (Human)) | BDBM50475499
(CHEMBL198575)Show SMILES ONC(=O)CCCCC(=O)NCCCCN(Cc1ccccc1-c1ccccc1)Cc1ccccc1-c1ccccc1 Show InChI InChI=1S/C36H41N3O3/c40-35(23-11-12-24-36(41)38-42)37-25-13-14-26-39(27-31-19-7-9-21-33(31)29-15-3-1-4-16-29)28-32-20-8-10-22-34(32)30-17-5-2-6-18-30/h1-10,15-22,42H,11-14,23-28H2,(H,37,40)(H,38,41) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 9.63E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Wayne State University
Curated by ChEMBL
| Assay Description
In vitro inhibitory concentration against Histone deacetylase (HDAC) at 1 uM concentration |
J Med Chem 48: 6350-65 (2005)
Article DOI: 10.1021/jm0505009
BindingDB Entry DOI: 10.7270/Q2KW5JSP |
More data for this
Ligand-Target Pair | |
Histone deacetylase
(Homo sapiens (Human)) | BDBM50475501
(CHEMBL541894)Show SMILES Br.CC(C)(C)c1ccc(CNCCCCNCCCNC(=O)CCCCC(O)=O)cc1 Show InChI InChI=1S/C24H41N3O3/c1-24(2,3)21-13-11-20(12-14-21)19-26-16-7-6-15-25-17-8-18-27-22(28)9-4-5-10-23(29)30/h11-14,25-26H,4-10,15-19H2,1-3H3,(H,27,28)(H,29,30) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 9.85E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Wayne State University
Curated by ChEMBL
| Assay Description
In vitro inhibitory concentration against Histone deacetylase (HDAC) at 1 uM concentration |
J Med Chem 48: 6350-65 (2005)
Article DOI: 10.1021/jm0505009
BindingDB Entry DOI: 10.7270/Q2KW5JSP |
More data for this
Ligand-Target Pair | |
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